手性活性粒子柔性链的螺旋折叠。

IF 2.3 4区 物理与天体物理 Q3 PHYSICS, CONDENSED MATTER
Shalabh K Anand
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引用次数: 0

摘要

我们利用计算机模拟研究了由手性活性布朗粒子组成的二维柔性聚合物链。在手性活性布朗力的作用下,链的旋转半径显著减小。我们进一步确定螺旋的形成使用切线-切线相关来表征链的内部结构。聚合物链形成一对螺旋,在聚合物的两端有相反的螺旋转。我们计算了两个螺旋的转数,发现总转数随角频率和P{'e} clelet数的增加而增加。然而,当P{'e} clelet数很高时,螺旋变弱,旋转次数减少。我们用匝数画一个相图。端到端相关表现出振荡行为,这表明了链的旋转动力学。我们从端到端矢量量化旋转频率,它遵循指数$3/2$的幂律行为。我们还提供了旋转半径与链长之间的标度关系,并且在手性有源力存在时指数显着降低。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Spiral folding of a flexible chain of chiral active particles.

We investigate a flexible polymer chain made up of chiral active Brownian particles in two dimensions using computer simulations. In the presence of chiral active Brownian forces, the radius of gyration of the chain reduces significantly. We further identify the formation of spirals using the tangent-tangent correlation to characterize the internal structure of the chain. The polymer chain forms a pair of spirals with opposite spiral turns on both ends of the polymer. We compute the number of turns of both spirals, and find that the total number of turns increases with angular frequency as well as Péclet number. However, the spirals become weak and the number of turns decreases at a very high Péclet number. We draw a phase diagram using the turn number. The end-to-end correlation displays oscillatory behavior, which signifies the rotational dynamics of the chain. We quantify the rotation frequency from the end-to-end vector, which follows a power law behavior with exponent3/2. We also provide a scaling relation between the radius of gyration and the chain length, and the exponent decreases significantly in the presence of chiral active forces.

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来源期刊
Journal of Physics: Condensed Matter
Journal of Physics: Condensed Matter 物理-物理:凝聚态物理
CiteScore
5.30
自引率
7.40%
发文量
1288
审稿时长
2.1 months
期刊介绍: Journal of Physics: Condensed Matter covers the whole of condensed matter physics including soft condensed matter and nanostructures. Papers may report experimental, theoretical and simulation studies. Note that papers must contain fundamental condensed matter science: papers reporting methods of materials preparation or properties of materials without novel condensed matter content will not be accepted.
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